(E)-6-[2-(dimethylamino)ethenyl]-fulvene

C10H13N — CID 13280603

IUPAC(E)-3-cyclopenta-2,4-dien-1-ylidene-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)/C=C/C=C1C=CC=C1
InChIInChI=1S/C10H13N/c1-11(2)9-5-8-10-6-3-4-7-10/h3-9H,1-2H3/b9-5+
InChIKeyMGTPRVHSQCUPLG-WEVVVXLNSA-N
MW147.22 g/mol
LogP2.40
Rot. Bonds2

About (E)-6-[2-(dimethylamino)ethenyl]-fulvene

(E)-6-[2-(dimethylamino)ethenyl]-fulvene (PubChem CID 13280603) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is (E)-3-cyclopenta-2,4-dien-1-ylidene-N,N-dimethylprop-1-en-1-amine.

Molecular Properties

Compound Name(E)-6-[2-(dimethylamino)ethenyl]-fulvene
PubChem CID13280603
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name(E)-3-cyclopenta-2,4-dien-1-ylidene-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)/C=C/C=C1C=CC=C1
InChIInChI=1S/C10H13N/c1-11(2)9-5-8-10-6-3-4-7-10/h3-9H,1-2H3/b9-5+
InChIKeyMGTPRVHSQCUPLG-WEVVVXLNSA-N
XLogP2.40
TPSA3.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity215

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-(Dimethylamino)fulvene
CID 136523
Ethanamine, 1-(2,4-cyclopentadien-1-ylidene)-N,N-dimethyl-
CID 585126
2-(Cyclopenta-2,4-dien-1-ylidene)-1-methyl-1,2-dihydropyridine
CID 13860310
3-Ethyl-1-methyl-1,2-dihydropyridine
CID 12506166
5-ethyl-1-methyl-2H-pyridine
CID 12506167
1,3,5-Collidin
CID 22046103
4-vinyl-N-ethylpyridine
CID 22178796
n-Methyl-4-vinylpyridine
CID 22463631
1,2-Dimethyl-5-vinyl pyridine
CID 69342103
Dimethylaminofulvene
CID 90007951
2-cyclopenta-1,4-dien-1-yl-N,N-dimethylethanamine
CID 12161648
(1E)-N,N,4-trimethylpenta-1,3-dien-1-amine
CID 14611150

Frequently Asked Questions

What is the IUPAC name of (E)-6-[2-(dimethylamino)ethenyl]-fulvene?
The IUPAC name of (E)-6-[2-(dimethylamino)ethenyl]-fulvene (CID 13280603) is (E)-3-cyclopenta-2,4-dien-1-ylidene-N,N-dimethylprop-1-en-1-amine.
What is the SMILES notation for (E)-6-[2-(dimethylamino)ethenyl]-fulvene?
The canonical SMILES for (E)-6-[2-(dimethylamino)ethenyl]-fulvene is CN(C)/C=C/C=C1C=CC=C1.
What is the InChIKey of (E)-6-[2-(dimethylamino)ethenyl]-fulvene?
The InChIKey is MGTPRVHSQCUPLG-WEVVVXLNSA-N. The full InChI is InChI=1S/C10H13N/c1-11(2)9-5-8-10-6-3-4-7-10/h3-9H,1-2H3/b9-5+.
What are the key properties of (E)-6-[2-(dimethylamino)ethenyl]-fulvene?
(E)-6-[2-(dimethylamino)ethenyl]-fulvene has a molecular weight of 147.22 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-[2-(dimethylamino)ethenyl]-fulvene is sourced from PubChem (CID 13280603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).